Oxophoebine
From DrugPedia: A Wikipedia for Drug discovery
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=1149 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=1149 Link to BIAdb Database] | ||
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Current revision
| Oxophoebine
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C20H15NO6 |
| Mol. mass | 365.3362 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
[edit] Description
Isolated from Xylopia aethiopica; structure in first source
The oxoaporphine alkaloids oxophoebine have been isolated from Xylopia aethiopica (Annonaceae). it showed selective toxicity against DNA repair and recombination deficient mutants of the yeast Saccharomyces cerevisae.
[edit] General Properties
*Molecular Weight
365.3362
*Molecular Formula
C20H15NO6
*IUPAC NAME
N/A
*Canonical Smiles
COC1=C(C(=C2C3=CC4=C(C=C3C(=O)C5=NC=CC1=C25)OCO4)OC)OC
*Isomeric Smiles
N/A
*XLogP
2.7
*Topological Polar Surface Area
76.1
